Vitas-M small molecule compound
N-(furan-2-ylmethyl)-4-oxo-4-[(1S,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]butanamide
Catalog ID
STL535635
SMILES O=C(NCc1ccco1)CCC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H23N3O4 MW 369.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O4/c24-18(21-10-16-3-2-8-27-16)6-7-19(25)22-11-14-9-15(13-22)17-4-1-5-20(26)23(17)12-14/h1-5,8,14-15H,6-7,9-13H2,(H,21,24)/t14-,15+/m0/s1InChIKey
KGSRZTCMIKWQGQ-LSDHHAIUSA-NSynonyms
1212287-13-2~(N)(furan2ylmethyl)4oxo4((1~(R)9~(S))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)butanamide
1212287132
42506838
InChI=1SC20H23N3O4c2418(2110163282716)6719(25)221114915(1322)1741520(26)23(17)1214h1581415H67913H2(H2124)t1415+m0s1
MFCD12028956
N(furan2ylmethyl)4oxo4((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)butanamide
N(furan2ylmethyl)4oxo4((1S5S)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)butanamide
O=C(NCc1ccco1)CCC(=O)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1
ZINC000012296558
ZINC12296558
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